SCHEMBL675067

SCHEMBL675067

O=C(CSc1nc2ccccc2s1)c1ccc2[nH]c3nc(Cl)ccc3c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.58
ALPG P10696 1/20 0.58
GCGR P47871 1/20 0.58
POLB P06746 6/20 0.48
RECQL P46063 2/20 0.48
APEX1 P27695 1/20 0.48
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
NPC1 O15118 2/20 0.47
MAPT P10636 5/20 0.47
ALDH1A1 P00352 5/20 0.46
HPGD P15428 2/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
RAB9A P51151 1/20 0.45
GAA P10253 2/20 0.44
PTPN1 P18031 1/20 0.44
HSD17B10 Q99714 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL674476 0.86 ALPL (0.57) ALPLALPGGCGRPOLBRECQL
SCHEMBL675911 0.86 CTSL (0.46) ALPLALPGGCGRPOLBMEN1
SCHEMBL3667781 0.83 ALPL (0.56) ALPLALPGGCGRPOLBRECQL
SCHEMBL675108 0.82 CA1 (0.46) ALPLALPGGCGRPOLBRECQL
SCHEMBL16241842 0.82 GCGR (0.63) ALPLALPGGCGRPOLBRECQL
SCHEMBL13464071 0.81 ALPL (0.56) ALPLALPGGCGRPOLBRECQL
SCHEMBL675624 0.79 ALDH1A1 (0.49) GCGRPOLBMEN1KMT2ANPC1
SCHEMBL3664792 0.76 ALDH1A1 (0.56) MEN1KMT2ANPC1MAPTALDH1A1
SCHEMBL3665386 0.76 MAPT (0.39) ALPLALPGGCGRPOLBRECQL
SCHEMBL3466913 0.74 ALPG (1.00) ALPLALPGGCGRPOLBRECQL

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895744-B2 Alfa-carboline inhibitors of NPM-ALK, RET, and Bcr-Abl UNIVERSITA' DEGLI STUDI DI MILANO-BICOCCA (IT) 2014-11-25 US disclosed
US-20110281862-A1 ALFA-CARBOLINE INHIBITORS OF NPM-ALK, RET, AND BCR-ABL UNIVERSITA' DEGLI STUDI DI MILANO - BICOCCA (IT) 2011-11-17 US disclosed
EP-2161271-A1 Alpha-carboline inhibitors of NMP-ALK, RET, and Bcr-Abl Università Degli Studi Di Milano - Bicocca (IT) 2010-03-10 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110281862-A1 ALFA-CARBOLINE INHIBITORS OF NPM-ALK, RET, AND BCR-ABL ALK, BCR, NPM1 ALPL 512/4885ALPG 3471/4885GCGR 3530/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.